| SpectraBase Compound ID | 6mZAzKj8q3I |
|---|---|
| InChI | InChI=1S/C46H74O21/c1-21(16-18-47)13-11-15-24(4)42(57)65-41-39(66-45-36(55)34(53)31(50)26(6)61-45)32(51)27(7)62-46(41)67-40-37(56)44(63-28(8)38(40)64-29(9)48)58-19-17-22(2)12-10-14-23(3)20-59-43-35(54)33(52)30(49)25(5)60-43/h14-17,25-28,30-41,43-47,49-56H,10-13,18-20H2,1-9H3/b21-16-,22-17-,23-14+,24-15+/t25-,26+,27+,28-,30-,31+,32+,33+,34-,35+,36-,37+,38-,39-,40-,41-,43+,44+,45+,46+/m0/s1 |
| InChIKey | JBRRGJXTNQIPEO-UHICAFLWSA-N |
| Mol Weight | 963.1 g/mol |
| Molecular Formula | C46H74O21 |
| Exact Mass | 962.472259 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D5bpBiHW0lR |
|---|---|
| Name | #5;(2E,6Z)-2,6-DIMETHYL-8-[(O-ALPHA-L-RHAMNOPYRANOSYL-(1->3)-(2-O-((2E,6Z)-8-HYDROXY-2,6-DIMETHYLOCTADIENOYL)-ALPHA-L-RHAMNOPYRANOSYL)-(1->3)-4-O-ACETYL |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H74O21 |
| InChI | InChI=1S/C46H74O21/c1-21(16-18-47)13-11-15-24(4)42(57)65-41-39(66-45-36(55)34(53)31(50)26(6)61-45)32(51)27(7)62-46(41)67-40-37(56)44(63-28(8)38(40)64-29(9)48)58-19-17-22(2)12-10-14-23(3)20-59-43-35(54)33(52)30(49)25(5)60-43/h14-17,25-28,30-41,43-47,49-56H,10-13,18-20H2,1-9H3/b21-16-,22-17-,23-14+,24-15+/t25-,26+,27+,28-,30-,31+,32+,33+,34-,35+,36-,37+,38-,39-,40-,41-,43+,44+,45+,46+/m0/s1 |
| InChIKey | JBRRGJXTNQIPEO-UHICAFLWSA-N |
| Literature Reference Author | R.ANERO,A.DIAZ-LANZA,E.OLLIVIER,B.BAGHDIKIAN,G.BALANSARD,M.B ARNABE |
| Literature Reference Citation | PHYTOCHEM.,69,805(2008) |
| Literature Reference DOI | 10.1016/j.phytochem.2007.09.024 |
| Molecular Weight | 963.081 g/mol |
| Sample ID | 43208 |
| Solvent | CDCl3 |